EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H48O2 |
| Net Charge | 0 |
| Average Mass | 404.679 |
| Monoisotopic Mass | 404.36543 |
| SMILES | CC(C)CCCC(C)/C=C\CC(C)CCCC/C=C\CC/C=C\CCCC(=O)O |
| InChI | InChI=1S/C27H48O2/c1-24(2)18-16-20-26(4)22-17-21-25(3)19-14-12-10-8-6-5-7-9-11-13-15-23-27(28)29/h6,8-9,11,17,22,24-26H,5,7,10,12-16,18-21,23H2,1-4H3,(H,28,29)/b8-6-,11-9-,22-17- |
| InChIKey | PRGDQWKNVBYEKH-IZJJPQSLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 24:3(5Z,9Z,17Z)(15Me,19Me,23Me) (CHEBI:187367) is a very long-chain fatty acid (CHEBI:27283) |
| IUPAC Name |
|---|
| (5Z,9Z,17Z)-15,19,23-trimethyltetracosa-5,9,17-trienoic acid |
| Manual Xrefs | Databases |
|---|---|
| 113368978 | ChemSpider |